ethyl-(2-methylprop-2-enyl)-[(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)methyl]azanium

Systemtic Name: ethyl-(2-methylprop-2-enyl)-[(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)methyl]azanium Openeye Name: ethyl-(2-methylallyl)-[[1-oxo-4-(2-thienyl)phthalazin-2-yl]methyl]ammonium CAS Name: ethyl-(2-methylprop-2-enyl)-[(1-oxo-4-thiophen-2-yl-2-phthalazinyl)methyl]ammonium IUPAC Name: ethyl-(2-methylprop-2-enyl)-[(1-oxo-4-thiophen-2-ylphthalazin-2-yl)methyl]azanium Traditional Name: ethyl-[[1-keto-4-(2-thienyl)phthalazin-2-yl]methyl]-(2-methylallyl)ammonium Formula: C19H22N3OS+ MolecularWeight: 340.46248

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=C)C)CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC=CS3

Isomeric SMILES

CC[NH+](CC(=C)C)CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC=CS3

InChI

InChI=1S/C19H21N3OS/c1-4-21(12-14(2)3)13-22-19(23)16-9-6-5-8-15(16)18(20-22)17-10-7-11-24-17/h5-11H,2,4,12-13H2,1,3H3/p+1